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Substance Name: Apernomine
RN: 138605-80-8
InChIKey: IVSAQJKXNVGQKB-UHFFFAOYSA-N

Molecular Formula

  • C28-H39-N-O2

Molecular Weight

  • 421.621
 
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Names and Synonyms

Name of Substance

  • Apernomine

Synonym

  • (+)-Aspernomine

Systematic Name

  • 6H-7,12b-Methanobenzo(b)naphth(2,1-d)azocin-6-one, 1,2,3,4,4a,4b,5,7,8,13,14,14a-dodecahydro-4-hydroxy-1,14a-dimethyl-4a-(4-methyl-3-pentenyl)-, (1R,4S,4aS,4bR,7S,12bR,14aS)-rel-(+)-

Registry Numbers

CAS Registry Number

  • 138605-80-8

System Generated Number

  • 0138605808

Structure Descriptors

InChI

1S/C28H39NO2/c1-18(2)8-7-13-28-24-16-23(30)22-17-27(24,20-9-5-6-10-21(20)29-22)15-14-26(28,4)19(3)11-12-25(28)31/h5-6,8-10,19,22,24-25,29,31H,7,11-17H2,1-4H3

InChIKey

IVSAQJKXNVGQKB-UHFFFAOYSA-N

Smiles

c1cc2c(N[C@@H]3C(C[C@@H]4[C@@]2(C3)CC[C@@]2([C@@]4([C@@H](CC[C@@H]2C)O)CC\C=C(\C)C)C)=O)cc1